2-(3,4-dimethylphenoxy)-N-[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]acetamide
Chemical Structure Depiction of
2-(3,4-dimethylphenoxy)-N-[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]acetamide
2-(3,4-dimethylphenoxy)-N-[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]acetamide
Compound characteristics
| Compound ID: | F527-0036 |
| Compound Name: | 2-(3,4-dimethylphenoxy)-N-[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]acetamide |
| Molecular Weight: | 420.49 |
| Molecular Formula: | C22 H20 N4 O3 S |
| Smiles: | Cc1ccc(cc1C)OCC(NCC1=CC(N2C(=N1)SC(c1ccccc1)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6232 |
| logD: | 3.6223 |
| logSw: | -3.8108 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.97 |
| InChI Key: | NYIMCEQSBZWSRH-UHFFFAOYSA-N |